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5-[(4-Bromophenyl)imino]-5H-5.gamma.4-dibenzo[b,d]thiophene 5-oxide
SpectraBase Compound ID LTvmMvdWTGN
InChI InChI=1S/C18H12BrNOS/c19-13-9-11-14(12-10-13)20-22(21)17-7-3-1-5-15(17)16-6-2-4-8-18(16)22/h1-12H
InChIKey LHRKICDFGHXZQD-UHFFFAOYSA-N
Mol Weight 370.26 g/mol
Molecular Formula C18H12BrNOS
Exact Mass 368.982298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBIrooslmA2
Name 5-[(4-Bromophenyl)imino]-5H-5.gamma.4-dibenzo[b,d]thiophene 5-oxide
Appearance Pale yellow solid
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Exact Mass 368.982298183 u
Formula C18H12BrNOS
InChI InChI=1S/C18H12BrNOS/c19-13-9-11-14(12-10-13)20-22(21)17-7-3-1-5-15(17)16-6-2-4-8-18(16)22/h1-12H
InChIKey LHRKICDFGHXZQD-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201705025
Molecular Weight 370.264 g/mol
Quality 168
Reported Formula C18H13ONBrS
SMILES C1=2S(C3=C(C2C=CC=C1)C=CC=C3)(=NC1=CC=C(C=C1)Br)=O
SPLASH splash10-00di-0309000000-872edad93cd161caa56f
Source of Spectrum ACI-56-SM7-1l (DOI: 10.1002/anie.201705025)
Thin-Layer Chromatography 0.75 (pentane/EtOAc, 2:1)
Wiley ID 1896216